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- W2316652804 abstract "Consideration is given to recoupled-pair bonding and the origin of electronic hypervalence for formulations of the bonding for symmetric 4-electron 3-center ((4e,3c)) bonding units with one overlapping atomic orbital per atomic center. Molecular orbital and valence bond theory for symmetric (4e,3c) bonding units is redescribed and applied to aspects of the bonding for SF6 and CLi6. The results of minimal basis set calculations for CLi6 provide support for a hypothesis that two Li–C–Li (3e,3c) bonding units rather than two (4e,3c) bonding units are preferred for this molecule. Brief comments are also made on the use of and as valence bond structures for the three electron bond." @default.
- W2316652804 created "2016-06-24" @default.
- W2316652804 creator A5063917609 @default.
- W2316652804 date "2011-05-26" @default.
- W2316652804 modified "2023-09-23" @default.
- W2316652804 title "Recoupled-Pair Bonding and 4-Electron 3-Center Bonding Units" @default.
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- W2316652804 doi "https://doi.org/10.1021/jp111573z" @default.
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